Chem
J-GLOBAL ID：200907004860998926   Nikkaji number：J2.845B

1,3,5-Trinitrobenzene

1,3,5-トリニトロベンゼン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C6H3[N+]3O3[O-]3
Molecular formula furigana： C6-H3-N3-O6
Molecular weight： 213.105
InChI： InChI=1S/C6H3N3O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H
InChI key： UATJOMSPNYCXIX-UHFFFAOYSA-N
SMILES： [O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]
Systematic name  (3)：
  • 2,4,6-トリニトロベンゼン
  • 1,3,5-トリニトロベンゼン
  • 1,3,5-trinitrobenzene
Other name (6)：
  • ベンジット
  • sym-トリニトロベンゼン
  • Benzite
  • sym-Trinitrobenzene
  • 1,3,5-Trinitrobenzene
Show all
CAS registry number： 99-35-4
Regulation number (4)：
  • (3)-2753
  • EINECS2027527
  • DC3850000
  • TSCA(99-35-4)
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